1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone

C15H20N2O — CID 43684604

IUPAC1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2cc(NC3CCCC3)ccc21
InChIInChI=1S/C15H20N2O/c1-11(18)17-9-8-12-10-14(6-7-15(12)17)16-13-4-2-3-5-13/h6-7,10,13,16H,2-5,8-9H2,1H3
InChIKeyBAIYEQKGPJFURA-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.95
Rot. Bonds2

About 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone

1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone (PubChem CID 43684604) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone.

Molecular Properties

Compound Name1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone
PubChem CID43684604
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2cc(NC3CCCC3)ccc21
InChIInChI=1S/C15H20N2O/c1-11(18)17-9-8-12-10-14(6-7-15(12)17)16-13-4-2-3-5-13/h6-7,10,13,16H,2-5,8-9H2,1H3
InChIKeyBAIYEQKGPJFURA-UHFFFAOYSA-N
XLogP2.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[(1-acetyl-2,3-dihydroindol-5-yl)amino]piperidin-1-yl]ethanone
CID 4547632
1-[5-[(1,1-dioxothian-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone
CID 63911652
1-[5-[(2-methyloxolan-3-yl)amino]-2,3-dihydroindol-1-yl]ethanone
CID 82727443
4-(1-acetyl-2,3-dihydroindol-5-yl)-N-cycloheptylbenzamide
CID 53043799
1-[5-[2-(cyclopentylamino)propyl]-2,3-dihydroindol-1-yl]ethanone
CID 82262657
1-acetyl-N-cyclopentyl-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 3388851
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-bromoacetamide
CID 63679851
1-(1-acetyl-2,3-dihydroindol-5-yl)-3-(4-methylphenyl)urea
CID 17485020
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;hydrochloride
CID 119271734
1-acetyl-N-cycloheptyl-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 3453929
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119690426
N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1-acetyl-2,3-dihydroindole-5-sulfonamide
CID 17487399

Frequently Asked Questions

What is the IUPAC name of 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone?
The IUPAC name of 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone (CID 43684604) is 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone.
What is the SMILES notation for 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone?
The canonical SMILES for 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone is CC(=O)N1CCc2cc(NC3CCCC3)ccc21.
What is the InChIKey of 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone?
The InChIKey is BAIYEQKGPJFURA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11(18)17-9-8-12-10-14(6-7-15(12)17)16-13-4-2-3-5-13/h6-7,10,13,16H,2-5,8-9H2,1H3.
What are the key properties of 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone?
1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone has a molecular weight of 244.34 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(cyclopentylamino)-2,3-dihydroindol-1-yl]ethanone is sourced from PubChem (CID 43684604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).